179324-87-9 (硼替佐米中间体A,Bortezomib Intermediate A)

快速询单

结构式：

硼替佐米中间体AMOL文件

CAS号：

179324-87-9

中文名称：

硼替佐米中间体A

英文名称：

Bortezomib Intermediate A

分子式：

C₁₇H₂₉BF₃NO₄

分子量：

379.222676038742

API：

Bortezomib

硼替佐米中间体A(179324-87-9)名称与标识符

名称

中文别名：

(aR,3aS,4S,6S,7aR)-六氢-3a,8,8-三甲基-alpha-(2-甲基丙基)-4,6-甲桥-1,3,2-苯并二氧硼烷-2-甲胺 2,2,2-三氟乙酸盐;(αR)-(1S,2S,3R,5S)-蒎烷二醇-1-氨基-3-甲基丁烷-1-硼酯三氟醋酸盐;(1R)-(s)-蒎二醇 1-三氟乙酸铵-3-甲基丁烷-1-硼;(aR,3aS,4S,6S,7aR)-六氢-3a,8,8-三甲基-alpha-(2-甲基丙基)-4,6-甲桥-1,3,2-苯并二氧硼烷;硼替佐米中间体;硼替佐米中间体1;硼替佐米中间体A;(ALPHAR,3AS,4S,6S,7AR)-六氢-3A,8,8-三甲基-ALPHA-(2-甲基丙基)-4,6-甲撑-1,3,2-苯并二氧杂BOROLE-2-甲胺 2,2,2-三氟乙酸酯;(R)-1-氨基-3-甲基丁基硼酸蒎烷二醇酯三氟醋酸盐;(R)-六氢-三甲基-(2-甲基丙基)-甲桥-苯并二氧硼烷-甲胺-三氟乙酸盐;AR,3AS,4S,6S,7AR)-六氢-3A,8,8-三甲基-ALPHA-(2-甲基丙基)-4,6-甲桥-1,3,2-苯并二氧硼烷-2-甲胺 2,2,2-三氟乙酸盐,保特佐米(硼替佐米)中间体;硼替佐咪中间体;硼替佐米三氟乙酸盐中间体;保特佐米(硼替佐米)中间体;BORTEZOMIB中间体;硼替蒎烷二醇三氟乙酸盐;

英文别名：

(aR,3aS,4S,6S,7aR)-Hexahydro-3a,8,8-trimethyl-alpha-(2-methylpropyl)-4,6-methano-1,3,2-benzodioxaborole-2-methanamine 2,2,2-trifluoroacetate;(R)-BoroLeu-(+)-Pinanediol trifluoroacetate;(1R)-(S)-Pinanediol 1-ammonium trifluoroacetate-3-methylbutane-1-boronate;(1R)-(S)-PINANEDIOL-1-AMINO-3-METHYLBUTANE-1-BORONATE, TRIFLUOROACETATE;(R)-BoroLeu-(+)-Pinanediol-CF3COOH;(R)-BoroLeu-(+)-pinanediol-trifluoroacetate;(R)-Boroleucine-(1S,2S,3R,5S)-(+)-pinanediol ester trifluoroacetate;(αR)-(1S,2S,3R,5S)-P;(αR)-(1S,2S,3R,5S)-Pinanediol-1-amino-3-methylbutane-1-boronate Trifluoroacetate;(αR)-(1S,2S,3R,5S)-Pinanediol-1-amino-3-methylbutane-1-boronate Trifluoroacetic Acid Salt;(aR,3aS,4S,6S,7aR)-Hexahydro-3a,8,8-trimethyl-α-(2-methylpropyl)-4,6-methano-1,3,2-benzodioxaborole-2-methanamine 2,2,2-trifluoroacetate;Bortezomib INT A;Ixazomib intermediate;Bortezomib Intermediates;Bortezomib Intermediate 1;Bortezomib Intermediate A;Pinanedioltrifluoroacetate salt-;(R)-BoroLeu-(+)-Pinanediol-CF3CO2H;(R)-BoroLeu-(+)-Pinanediol-CF3COOH N-4;(R)-3-METHYL-1-((3AS,4S,6S,7AR)-3A,5,5-TRIMETHYLHEXAHYDRO-4,6-METHANOBENZO[D][1,3,2]DIOXABOROL-2-YL)BUTAN-1-AMINE 2,2,2-TRIFLUOROACETATE;(1R)-(S)-Pinanediol 1-ammoni;(1R)-3-methyl-1-[(1S,2S,6R,8S)-2,9,9-trimethyl-3,5-dioxa-4-boratricyclo[6.1.1.02?]decan-4-yl]butan-1-amine;2,2,2-trifluoroacetic acid;(R)-BoroLeu-(+)-Pinanedioltrifluoroacetate;AC-2355;(1R)-3-METHYL-1-[(1S,2S,6R,8S)-2,9,9-TRIMETHYL-3,5-DIOXA-4-BORATRICYCLO[6.1.1.0(2),?]DECAN-4-YL]BUTAN-1-AMINE; TRIFLUOROACETIC ACID;Z3082065227;(aR,3aS,4S,6S,7aR)-Hexahydro-3a,8,8-trimethyl-alpha-(2-methylpropyl)-4,6-methano-1,3,2-benzodioxaborole-2-methanamine 2,2,2-trifluor oacetate;(1R)-3-methyl-1-[(1S,2S,6R,8S)-2,9,9-trimethyl-3,5-dioxa-4-boratricyclo[6.1.1.0^{2,6}]decan-4-yl]butan-1-amine; trifluoroacetic acid;MFCD10566030;(alphaR)-(1S,2S,3R,5S)-Pinanediol-1-amino-3-methylbutane-1-boronate Trifluoroacetic Acid Salt;AKOS015896703;Trifluoroacetic acid--(1R)-3-methyl-1-[(3aS,4S,6S,7aR)-3a,5,5-trimethylhexahydro-2H-4,6-methano-1,3,2-benzodioxaborol-2-yl]butan-1-amine (1/1);(?R)-(1S,2S,3R,5S)-Pinanediol-1-amino-3-methylbutane-1-boronate Trifluoroacetic Acid Salt;EN300-7390232;Q-102518;(1R)-3-methyl-1-[(1S,2S,6R,8S)-2,9,9-trimethyl-3,5-dioxa-4-boratricyclo[6.1.1.02,6]decan-4-yl]butan-1-amine;2,2,2-trifluoroacetic acid;(1R)-3-methyl-1-[(1S,2S,6R,8S)-2,9,9-trimethyl-3,5-dioxa-4-boratricyclo[6.1.1.0?,?]decan-4-yl]butan-1-amine; trifluoroacetic acid;BS-2025;A846442;DTXSID00658025;(R)-BOROLEU-(+)-PINANEDIOL TFA;CS-W019140;(1R)-3-methyl-1-[(1S,2S,6R,8S)-2,9,9-trimethyl-3,5-dioxa-4-boratricyclo[6.1.1.0,2,6]decan-4-yl]butan-1-amine; trifluoroacetic acid;4,6-Methano-1,3,2-benzodioxaborole-2-methanamine, hexahydro-3a,8,8-trimethyl-alpha-(2-methylpropyl)-, (alphaR,3aS,4S,6S,7aR)-, 2,2,2-trifluoroacetate (1:1);AMY4256;(aR)-(1S,2S,3R,5S)-Pinanediol-1-amino-3-methylbutane-1-boronate Trifluoroacetic Acid Salt;

标识符

MDL：

MFCD10566030

InChIKey：

SRFQKJZNJYTMNI-CDVUYJLHSA-N

Inchi：

1S/C15H28BNO2.C2HF3O2/c1-9(2)6-13(17)16-18-12-8-10-7-11(14(10,3)4)15(12,5)19-16;3-2(4,5)1(6)7/h9-13H,6-8,17H2,1-5H3;(H,6,7)/t10-,11-,12+,13-,15-;/m0./s1

SMILES：

FC(C(=O)O)(F)F.O1B([C@H](CC(C)C)N)O[C@@H]2C[C@@H]3C[C@H]([C@]12C)C3(C)C

硼替佐米中间体A(179324-87-9)物化性质

实验特性

LogP : 4.38080
PSA : 81.78000

计算特性

精确分子量 : 379.21400
氢键供体数量 : 2
氢键受体数量 : 8
可旋转化学键数量 : 3
同位素质量 : 379.214
重原子数量 : 26
复杂度 : 457
同位素原子数量 : 0
确定原子立构中心数量 : 5
不确定原子立构中心数量 : 0
确定化学键立构中心数量 : 0
不确定化学键立构中心数量 : 0
共价键单元数量 : 2
疏水参数计算参考值（XlogP） : 无
互变异构体数量 : 无
表面电荷 : 0
拓扑分子极性表面积 : 81.8

硼替佐米中间体A(179324-87-9)安全信息

硼替佐米中间体A(179324-87-9)海关数据

海关编码：

29209090

硼替佐米中间体A(179324-87-9)推荐厂家更多厂家(105)

公司名称	手机号/电话	联系人	QQ	询单
山东柯尔生物科技有限公司	15376831117	王先生	318544585	询单
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山东铂源药业股份有限公司	19862156242	姜经理	1431366413	询单
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硼替佐米中间体A(179324-87-9) MSDS

基础信息

Material Safety Data Sheet

Section 1. Identi?cation of the substance
Product Name: (R)-Boroleucine-(1S,2S,3R,5S)-(+)-pinanediol ester tri?uoroacetate
Synonyms:

Section 2. Hazards identi?cation
Harmful by inhalation, in contact with skin, and if swallowed.

Section 3. Composition/information on ingredients.
Ingredient name: (R)-Boroleucine-(1S,2S,3R,5S)-(+)-pinanediol ester tri?uoroacetate
CAS number: 179324-87-9

Section 4. First aid measures
    Skin contact:        Immediately wash skin with copious amounts of water for at least 15 minutes while removing
    contaminated clothing and shoes. If irritation persists, seek medical attention.
    Eye contact:        Immediately wash skin with copious amounts of water for at least 15 minutes. Assure adequate
    ?ushing of the eyes by separating the eyelids with ?ngers. If irritation persists, seek medical
    attention.
    Inhalation:        Remove to fresh air. In severe cases or if symptoms persist, seek medical attention.
    Ingestion:        Wash out mouth with copious amounts of water for at least 15 minutes. Seek medical attention.

Section 5. Fire ?ghting measures
    In the event of a ?re involving this material, alone or in combination with other materials, use dry
    powder or carbon dioxide extinguishers. Protective clothing and self-contained breathing apparatus
    should be worn.

Section 6. Accidental release measures
    Personal precautions: Wear suitable personal protective equipment which performs satisfactorily and meets local/state/national
    standards.
    Respiratory precaution:        Wear approved mask/respirator
    Hand precaution:        Wear suitable gloves/gauntlets
    Skin protection:        Wear suitable protective clothing
    Eye protection:        Wear suitable eye protection
    Methods for cleaning up: Mix with sand or similar inert absorbent material, sweep up and keep in a tightly closed container
    for disposal. See section 12.
    Environmental precautions: Do not allow material to enter drains or water courses.

Section 7. Handling and storage
    Handling:        This product should be handled only by, or under the close supervision of, those properly quali?ed
    in the handling and use of potentially hazardous chemicals, who should take into account the ?re,
    health and chemical hazard data given on this sheet.
    Store in closed vessels, under ?20?C.
    Storage:

Section 8. Exposure Controls / Personal protection
    Engineering Controls: Use only in a chemical fume hood.
    Personal protective equipment: Wear laboratory clothing, chemical-resistant gloves and safety goggles.
    General hydiene measures: Wash thoroughly after handling. Wash contaminated clothing before reuse.

Section 9. Physical and chemical properties
    Appearance:        Not speci?ed
    Boiling point:        No data
    No data
    Melting point:
    Flash point:        No data
    Density:        No data
    Molecular formula:        C15H28BNO2.C2HF3O2
    Molecular weight:        379.2

Section 10. Stability and reactivity
    Conditions to avoid: Heat, ?ames and sparks.
    Materials to avoid: Oxidizing agents.
    Possible hazardous combustion products: Carbon monoxide, nitrogen oxides, hydrogen ?uoride.

Section 11. Toxicological information
No data.

Section 12. Ecological information
No data.

Section 13. Disposal consideration
Arrange disposal as special waste, by licensed disposal company, in consultation with local waste
disposal authority, in accordance with national and regional regulations.

Section 14. Transportation information
Non-harzardous for air and ground transportation.

Section 15. Regulatory information
    No chemicals in this material are subject to the reporting requirements of SARA Title III, Section
    302, or have known CAS numbers that exceed the threshold reporting levels established by SARA
    Title III, Section 313.

SECTION 16 - ADDITIONAL INFORMATION
N/A